Chemical ID: 6399634

Cc1c(sc(n1)NC(=O)c2ccccc2OC)C
Chemical ID:
6399634
Name [?]:
N-(4,5-dimethylthiazol-2-yl)-2-methoxy-benzamide
SMILES [?]:
Cc1c(sc(n1)NC(=O)c2ccccc2OC)C
InChi [?]:
InChI=1/C13H14N2O2S/c1-8-9(2)18-13(14-8)15-12(16)10-6-4-5-7-11(10)17-3/h4-7H,1-3H3,(H,14,15,16)
InChi Info:
AuxInfo=1/1/N:1,18,17,12,13,11,14,2,3,10,15,8,5,6,7,9,16,4/rA:18nCCCSCNNCOCCCCCCOCC/rB:s1;d2;s3;s4;s2d5;s5;s7;d8;s8;s10;d11;s12;d13;d10s14;s15;s16;s3;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H14N2O2S
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:6.51007
Area:444.397
Solvation:-4.59986
Coulombic:-32.3108
Bond Count [?]
All:19
Single:13
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:262.329
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.88
LogP (Chemaxon):2.28

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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